2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide

C12H21NO2 — CID 112604821

IUPAC2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)COC(C)(C)C
InChIInChI=1S/C12H21NO2/c1-6-8-13(9-7-2)11(14)10-15-12(3,4)5/h6-7H,1-2,8-10H2,3-5H3
InChIKeyDMLXFFCHAVNROK-UHFFFAOYSA-N
MW211.30 g/mol
LogP2.00
Rot. Bonds6

About 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide

2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide (PubChem CID 112604821) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide
PubChem CID112604821
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)COC(C)(C)C
InChIInChI=1S/C12H21NO2/c1-6-8-13(9-7-2)11(14)10-15-12(3,4)5/h6-7H,1-2,8-10H2,3-5H3
InChIKeyDMLXFFCHAVNROK-UHFFFAOYSA-N
XLogP2.00
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[2-[bis(prop-2-enyl)amino]-2-oxoethoxy]-N-ethyl-N-prop-2-enylacetamide
CID 166930748
2-ethoxy-2-methyl-N,N-bis(prop-2-enyl)propanamide
CID 146490139
1-[(2-methylpropan-2-yl)oxy]pent-4-en-2-one
CID 105083103
5-[bis(prop-2-enyl)amino]-3,3-dimethyl-5-oxopentanoic acid
CID 55157304
2-hydroxy-N,N-bis(prop-2-enyl)acetamide
CID 13241436
N-ethyl-2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetamide
CID 112604720
2-[4-[2-[4-[2-[bis(prop-2-enyl)amino]-2-oxoethoxy]-3,5-dibromophenyl]-2-methylpropyl]-2,6-dibromophenoxy]-N,N-bis(prop-2-enyl)acetamide
CID 18522549
2-fluoro-N,N-bis(prop-2-enyl)acetamide
CID 176847586
2-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 115775668
methyl 2-[ethyl-[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]acetate
CID 112603588
N-ethyl-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604773
3,3,3-trifluoro-N,N-bis(prop-2-enyl)propanamide
CID 176847603

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide (CID 112604821) is 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide is C=CCN(CC=C)C(=O)COC(C)(C)C.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide?
The InChIKey is DMLXFFCHAVNROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-6-8-13(9-7-2)11(14)10-15-12(3,4)5/h6-7H,1-2,8-10H2,3-5H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide?
2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide has a molecular weight of 211.30 g/mol, XLogP of 2.00, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-N,N-bis(prop-2-enyl)acetamide is sourced from PubChem (CID 112604821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).